5'-a sc sa sc sc sc sa sa su su sc su sg sa sa sa sa su sg sg-3'

Structural Information

Molecular Formula

C₁₉₁H₂₃₇N₇₈O₁₁₅P₁₉S₁₉

SMILES

C1=CN(C(=O)N=C1N)C2C(C(C(O2)COP(=S)(O)OC3C(OC(C3O)N4C=NC5=C(N=CN=C54)N)CO)OP(=S)(O)OCC6C(C(C(O6)N7C=NC8=C(N=CN=C87)N)O)OP(=S)(O)OCC9C(C(C(O9)N1C=CC(=NC1=O)N)O)OP(=S)(O)OCC1C(C(C(O1)N1C=CC(=NC1=O)N)O)OP(=S)(O)OCC1C(C(C(O1)N1C=CC(=NC1=O)N)O)OP(=S)(O)OCC1C(C(C(O1)N1C=NC2=C(N=CN=C21)N)O)OP(=S)(O)OCC1C(C(C(O1)N1C=NC2=C(N=CN=C21)N)O)OP(=S)(O)OCC1C(C(C(O1)N1C=CC(=O)NC1=O)O)OP(=S)(O)OCC1C(C(C(O1)N1C=CC(=O)NC1=O)O)OP(=S)(O)OCC1C(C(C(O1)N1C=CC(=NC1=O)N)O)OP(=S)(O)OCC1C(C(C(O1)N1C=CC(=O)NC1=O)O)OP(=S)(O)OCC1C(C(C(O1)N1C=NC2=C1N=C(NC2=O)N)O)OP(=S)(O)OCC1C(C(C(O1)N1C=NC2=C(N=CN=C21)N)O)OP(=S)(O)OCC1C(C(C(O1)N1C=NC2=C(N=CN=C21)N)O)OP(=S)(O)OCC1C(C(C(O1)N1C=NC2=C(N=CN=C21)N)O)OP(=S)(O)OCC1C(C(C(O1)N1C=NC2=C(N=CN=C21)N)O)OP(=S)(O)OCC1C(C(C(O1)N1C=CC(=O)NC1=O)O)OP(=S)(O)OCC1C(C(C(O1)N1C=NC2=C1N=C(NC2=O)N)O)OP(=S)(O)OCC1C(C(C(O1)N1C=NC2=C1N=C(NC2=O)N)O)O)O

InChI

InChI=1S/C191H237N78O115P19S19/c192-78-1-10-250(183(299)235-78)161-101(278)120(60(348-161)21-328-386(309,405)366-119-58(19-270)346-170(100(119)277)259-47-224-87-138(197)208-39-216-146(87)259)370-392(315,411)337-30-69-129(110(287)171(357-69)260-48-225-88-139(198)209-40-217-147(88)260)377-396(319,415)334-25-64-123(104(281)164(352-64)253-13-4-81(195)238-186(253)302)368-388(311,407)329-22-61-121(102(279)162(349-61)251-11-2-79(193)236-184(251)300)367-387(310,406)330-23-63-124(105(282)165(351-63)254-14-5-82(196)239-187(254)303)371-393(316,412)338-31-70-132(113(290)174(358-70)263-51-228-91-142(201)212-43-220-150(91)263)380-399(322,418)339-32-71-130(111(288)172(359-71)261-49-226-89-140(199)210-41-218-148(89)261)378-397(320,416)335-28-67-126(107(284)167(355-67)256-16-7-84(272)241-189(256)305)373-391(314,410)333-27-65-125(106(283)166(353-65)255-15-6-83(271)240-188(255)304)372-390(313,409)331-24-62-122(103(280)163(350-62)252-12-3-80(194)237-185(252)301)369-389(312,408)332-26-66-127(108(285)168(354-66)257-17-8-85(273)242-190(257)306)374-395(318,414)345-38-77-137(118(295)179(365-77)269-57-234-97-156(269)246-182(207)249-159(97)298)384-403(326,422)343-36-75-135(116(293)177(363-75)266-54-231-94-145(204)215-46-223-153(94)266)383-402(325,421)342-35-74-134(115(292)176(362-74)265-53-230-93-144(203)214-45-222-152(93)265)382-401(324,420)341-34-73-133(114(291)175(361-73)264-52-229-92-143(202)213-44-221-151(92)264)381-400(323,419)340-33-72-131(112(289)173(360-72)262-50-227-90-141(200)211-42-219-149(90)262)379-398(321,417)336-29-68-128(109(286)169(356-68)258-18-9-86(274)243-191(258)307)375-394(317,413)344-37-76-136(117(294)178(364-76)268-56-233-96-155(268)245-181(206)248-158(96)297)376-385(308,404)327-20-59-98(275)99(276)160(347-59)267-55-232-95-154(267)244-180(205)247-157(95)296/h1-18,39-77,98-137,160-179,270,275-295H,19-38H2,(H,308,404)(H,309,405)(H,310,406)(H,311,407)(H,312,408)(H,313,409)(H,314,410)(H,315,411)(H,316,412)(H,317,413)(H,318,414)(H,319,415)(H,320,416)(H,321,417)(H,322,418)(H,323,419)(H,324,420)(H,325,421)(H,326,422)(H2,192,235,299)(H2,193,236,300)(H2,194,237,301)(H2,195,238,302)(H2,196,239,303)(H2,197,208,216)(H2,198,209,217)(H2,199,210,218)(H2,200,211,219)(H2,201,212,220)(H2,202,213,221)(H2,203,214,222)(H2,204,215,223)(H,240,271,304)(H,241,272,305)(H,242,273,306)(H,243,274,307)(H3,205,244,247,296)(H3,206,245,248,297)(H3,207,246,249,298)

InChIKey

HQXVXACTVGDYTO-UHFFFAOYSA-N

Compound name

1-[4-[[3-[[3-[[5-(2-amino-6-oxo-1H-purin-9-yl)-3-[[3-[[3-[[3-[[3-[[3-[[5-(2-amino-6-oxo-1H-purin-9-yl)-3-[[5-(2-amino-6-oxo-1H-purin-9-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-hydroxyphosphinothioyl]oxy-4-hydroxyoxolan-2-yl]methoxy-hydroxyphosphinothioyl]oxy-5-(2,4-dioxopyrimidin-1-yl)-4-hydroxyoxolan-2-yl]methoxy-hydroxyphosphinothioyl]oxy-5-(6-aminopurin-9-yl)-4-hydroxyoxolan-2-yl]methoxy-hydroxyphosphinothioyl]oxy-5-(6-aminopurin-9-yl)-4-hydroxyoxolan-2-yl]methoxy-hydroxyphosphinothioyl]oxy-5-(6-aminopurin-9-yl)-4-hydroxyoxolan-2-yl]methoxy-hydroxyphosphinothioyl]oxy-5-(6-aminopurin-9-yl)-4-hydroxyoxolan-2-yl]methoxy-hydroxyphosphinothioyl]oxy-4-hydroxyoxolan-2-yl]methoxy-hydroxyphosphinothioyl]oxy-5-(2,4-dioxopyrimidin-1-yl)-4-hydroxyoxolan-2-yl]methoxy-hydroxyphosphinothioyl]oxy-5-(4-amino-2-oxopyrimidin-1-yl)-4-hydroxyoxolan-2-yl]methoxy-hydroxyphosphinothioyl]oxy-5-[[[2-[[[2-[[[2-[[[5-(4-amino-2-oxopyrimidin-1-yl)-2-[[[5-(4-amino-2-oxopyrimidin-1-yl)-2-[[[5-(4-amino-2-oxopyrimidin-1-yl)-2-[[[2-[[[5-(4-amino-2-oxopyrimidin-1-yl)-2-[[[5-(6-aminopurin-9-yl)-4-hydroxy-2-(hydroxymethyl)oxolan-3-yl]oxy-hydroxyphosphinothioyl]oxymethyl]-4-hydroxyoxolan-3-yl]oxy-hydroxyphosphinothioyl]oxymethyl]-5-(6-aminopurin-9-yl)-4-hydroxyoxolan-3-yl]oxy-hydroxyphosphinothioyl]oxymethyl]-4-hydroxyoxolan-3-yl]oxy-hydroxyphosphinothioyl]oxymethyl]-4-hydroxyoxolan-3-yl]oxy-hydroxyphosphinothioyl]oxymethyl]-4-hydroxyoxolan-3-yl]oxy-hydroxyphosphinothioyl]oxymethyl]-5-(6-aminopurin-9-yl)-4-hydroxyoxolan-3-yl]oxy-hydroxyphosphinothioyl]oxymethyl]-5-(6-aminopurin-9-yl)-4-hydroxyoxolan-3-yl]oxy-hydroxyphosphinothioyl]oxymethyl]-5-(2,4-dioxopyrimidin-1-yl)-4-hydroxyoxolan-3-yl]oxy-hydroxyphosphinothioyl]oxymethyl]-3-hydroxyoxolan-2-yl]pyrimidine-2,4-dione

Related CIDs

• CID 16130134